AG006A50

Name: tert-Butyl 3-[(3-bromophenyl)sulfanyl]azetidine-1-carboxylate
Brand: Angene Chemical
SKU: AG006A50

959245-73-9 | tert-Butyl 3-[(3-bromophenyl)sulfanyl]azetidine-1-carboxylate

AG006A50

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CAS Number	959245-73-9
Catalog Number	AG006A50(AGN-PC-07B7A1)
Chemical Name	tert-Butyl 3-[(3-bromophenyl)sulfanyl]azetidine-1-carboxylate
IUPAC Name	tert-butyl 3-(3-bromophenyl)sulfanylazetidine-1-carboxylate
InChI	InChI=1S/C14H18BrNO2S/c1-14(2,3)18-13(17)16-8-12(9-16)19-11-6-4-5-10(15)7-11/h4-7,12H,8-9H2,1-3H3
InChI Key	XPQDPMFUBASWFD-UHFFFAOYSA-N
MDL Number	MFCD11036123
Molecular Formula	C14H18BrNO2S
Molecular Weight	344.2672
SMILES	Brc1cccc(c1)SC1CN(C1)C(=O)OC(C)(C)C
Synonyms	959245-73-9, tert-Butyl 3-[(3-bromophenyl)sulfanyl]azetidine-1-carboxylate, 1-BOC-3-(3-BROMO-PHENYLSULFANYL)-AZETIDINE, tert-Butyl 3-((3-bromophenyl)thio)azetidine-1-carboxylate, CTK5H8429, DTXSID00669717, ZINC39325920, AKOS027253187, V9852, C14H18BrNO2S,

Complexity	326
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	343.024g/mol
Formal Charge	0
Heavy Atom Count	19
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	344.267g/mol
Monoisotopic Mass	343.024g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	54.8A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.8

CERTIFICATE OF ANALYSIS

Analysis Data:

Test:

Result:

Conclusion: The above product meets the specifications of Angene.

Analyst:Chase

Date:

Reviewed by:Jessie

Date:

Angene International Limited